[2-(6-chloro-8-nitro-9H-beta-carbolin-7-ylsulfanyl)-ethyl]-dimethyl-amine

HCID 67166181
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Basic information

Standard SMILES
CN(C)CCSc1c(Cl)cc2c([nH]c3cnccc32)c1[N+](=O)[O-]
InChIKey
JIILUWWXYBUTPB-UHFFFAOYSA-N
Molecular formula
C15H15ClN4O2S
Average molar mass
350.8 g/mol

Names & identifiers

Preferred name
[2-(6-chloro-8-nitro-9H-beta-carbolin-7-ylsulfanyl)-ethyl]-dimethyl-amine
IUPAC
2-[(6-chloro-8-nitro-9H-pyrido[3,4-b]indol-7-yl)sulfanyl]-N,N-dimethylethanamine

Names & synonyms

SCHEMBL1801594JIILUWWXYBUTPB-UHFFFAOYSA-N[2-(6-chloro-8-nitro-9H-beta-carbolin-7-ylsulfanyl)-ethyl]-dimethyl-amine

Database identifiers

PubChem CID
67166181

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
103 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
23

Related reactions

6 records
New reaction record

Compound notes

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[2-(6-chloro-8-nitro-9H-beta-carbolin-7-ylsulfanyl)-ethyl]-dimethyl-amine (HCID 67166181)｜Huagongshe